ethyl {[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | V008-2807 |
| Compound Name: | ethyl {[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 387.89 |
| Molecular Formula: | C19 H18 Cl N3 O2 S |
| Salt: | not_available |
| Smiles: | CCOC(CSc1nnc(c2ccccc2[Cl])n1c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6537 |
| logD: | 4.6537 |
| logSw: | -4.7845 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.143 |
| InChI Key: | WNSRHFWDCZDUCO-UHFFFAOYSA-N |